6-pyrrolidin-1-yl-1,5-dihydropyrazolo[5,4-d]pyrimidin-4-one

C9H11N5O — CID 166197479

IUPAC6-pyrrolidin-1-yl-1,5-dihydropyrazolo[5,4-d]pyrimidin-4-one
SMILESO=c1[nH]c(N2CCCC2)nc2[nH]ncc12
InChIInChI=1S/C9H11N5O/c15-8-6-5-10-13-7(6)11-9(12-8)14-3-1-2-4-14/h5H,1-4H2,(H2,10,11,12,13,15)
InChIKeyXUICKELKDUXNHH-UHFFFAOYSA-N
MW205.22 g/mol
LogP0.25
Rot. Bonds1

About 6-pyrrolidin-1-yl-1,5-dihydropyrazolo[5,4-d]pyrimidin-4-one

6-pyrrolidin-1-yl-1,5-dihydropyrazolo[5,4-d]pyrimidin-4-one (PubChem CID 166197479) has the molecular formula C9H11N5O and a molecular weight of 205.22 g/mol. Its IUPAC name is 6-pyrrolidin-1-yl-1,5-dihydropyrazolo[5,4-d]pyrimidin-4-one.

Molecular Properties

Compound Name6-pyrrolidin-1-yl-1,5-dihydropyrazolo[5,4-d]pyrimidin-4-one
PubChem CID166197479
Molecular FormulaC9H11N5O
Molecular Weight205.22 g/mol
Exact Mass205.10
IUPAC Name6-pyrrolidin-1-yl-1,5-dihydropyrazolo[5,4-d]pyrimidin-4-one
SMILESO=c1[nH]c(N2CCCC2)nc2[nH]ncc12
InChIInChI=1S/C9H11N5O/c15-8-6-5-10-13-7(6)11-9(12-8)14-3-1-2-4-14/h5H,1-4H2,(H2,10,11,12,13,15)
InChIKeyXUICKELKDUXNHH-UHFFFAOYSA-N
XLogP0.25
TPSA77.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.22
LogP ≤ 50.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-pyrrolidin-1-yl-1,5-dihydropyrazolo[5,4-d]pyrimidin-4-one?
The IUPAC name of 6-pyrrolidin-1-yl-1,5-dihydropyrazolo[5,4-d]pyrimidin-4-one (CID 166197479) is 6-pyrrolidin-1-yl-1,5-dihydropyrazolo[5,4-d]pyrimidin-4-one.
What is the SMILES notation for 6-pyrrolidin-1-yl-1,5-dihydropyrazolo[5,4-d]pyrimidin-4-one?
The canonical SMILES for 6-pyrrolidin-1-yl-1,5-dihydropyrazolo[5,4-d]pyrimidin-4-one is O=c1[nH]c(N2CCCC2)nc2[nH]ncc12.
What is the InChIKey of 6-pyrrolidin-1-yl-1,5-dihydropyrazolo[5,4-d]pyrimidin-4-one?
The InChIKey is XUICKELKDUXNHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N5O/c15-8-6-5-10-13-7(6)11-9(12-8)14-3-1-2-4-14/h5H,1-4H2,(H2,10,11,12,13,15).
What are the key properties of 6-pyrrolidin-1-yl-1,5-dihydropyrazolo[5,4-d]pyrimidin-4-one?
6-pyrrolidin-1-yl-1,5-dihydropyrazolo[5,4-d]pyrimidin-4-one has a molecular weight of 205.22 g/mol, XLogP of 0.25, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-pyrrolidin-1-yl-1,5-dihydropyrazolo[5,4-d]pyrimidin-4-one is sourced from PubChem (CID 166197479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).